In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 24th, 2011 | 36 | No |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 8.03 | 15.77 | -57.35 | 0 | 5 | -1 | 70 | 494.627 | 15 | ↓ |
Lo Low (pH 4.5-6) | 8.03 | 15.02 | -11.08 | 1 | 5 | 0 | 67 | 495.635 | 15 | ↓ |